1-(trifluoromethyl)-1H-imidazole
Basic information
- CAS
77392-77-9- Standard SMILES
FC(F)(F)n1ccnc1- InChIKey
RLXUXICUOSILHE-UHFFFAOYSA-N- Molecular formula
- C4H3F3N2
- Average molar mass
- 136.08 g/mol
- Monoisotopic mass
- 136.02483259
Names & identifiers
- Preferred name
- 1-(trifluoromethyl)-1H-imidazole
- IUPAC
- 1-(trifluoromethyl)imidazole
Names & synonyms
1-(trifluoromethyl)-1H-Imidazole77392-77-9RefChem:428793972-915-11H-Imidazole, 1-(trifluoromethyl)-1-(trifluoromethyl)imidazoleN-trifluoromethylimidazoleSCHEMBL420876SCHEMBL4679850SCHEMBL6462877SCHEMBL8713161SCHEMBL9903249
Show more names
RLXUXICUOSILHE-UHFFFAOYSA-NAKOS015996096
Database identifiers
- CAS
77392-77-9- PubChem CID
- 12899028
- EC Number
- 972-915-1
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 100
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…